2-azanyl-5-[4-azanyl-2-(2-sulfoethylsulfonyl)phenoxy]benzenesulfonic acid

Systemtic Name: 2-azanyl-5-[4-azanyl-2-(2-sulfoethylsulfonyl)phenoxy]benzenesulfonic acid Openeye Name: 2-amino-5-[4-amino-2-(2-sulfoethylsulfonyl)phenoxy]benzenesulfonic acid CAS Name: 2-amino-5-[4-amino-2-(2-sulfoethylsulfonyl)phenoxy]benzenesulfonic acid IUPAC Name: 2-amino-5-[4-amino-2-(2-sulfoethylsulfonyl)phenoxy]benzenesulfonic acid Traditional Name: 2-amino-5-[4-amino-2-(2-sulfoethylsulfonyl)phenoxy]besylic acid Formula: C14H16N2O9S3 MolecularWeight: 452.47984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)S(=O)(=O)CCS(=O)(=O)O)OC2=CC(=C(C=C2)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1N)S(=O)(=O)CCS(=O)(=O)O)OC2=CC(=C(C=C2)N)S(=O)(=O)O

InChI

InChI=1S/C14H16N2O9S3/c15-9-1-4-12(14(7-9)26(17,18)5-6-27(19,20)21)25-10-2-3-11(16)13(8-10)28(22,23)24/h1-4,7-8H,5-6,15-16H2,(H,19,20,21)(H,22,23,24)